#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w6m n SER 2002N 0.00 -1.93 -2.16 0.00 3.41 -1.26 -4.09 113.62 107.58 1w6m n SER 2002Ca 0.00 -0.21 0.00 0.00 -0.26 0.00 0.00 58.87 58.40 1w6m n SER 2002Cb 0.00 -1.23 0.00 0.00 -0.26 0.00 0.00 64.21 62.72 1w6m n SER 2002CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1w6m n GLY 2003N 1.12 -0.40 3.76 5.00 0.00 0.36 -4.64 105.19 110.39 1w6m n GLY 2003Ca 0.02 -1.74 -0.39 0.00 0.00 0.00 0.00 46.02 43.91 1w6m n GLY 2003CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1w6m s LEU 2004N 0.00 3.98 -0.09 0.99 0.20 -1.25 -4.61 118.68 117.90 1w6m s LEU 2004Ca 0.00 2.73 0.00 0.00 0.69 0.00 0.00 54.13 57.56 1w6m s LEU 2004Cb 0.00 -4.14 0.02 0.00 -0.43 0.00 0.00 46.19 41.64 1w6m s LEU 2004CO 0.00 -1.30 -0.08 -0.69 -0.29 0.00 0.00 176.35 173.98 1w6m s VAL 2005N -1.30 0.99 -0.03 1.68 1.01 -1.26 -1.09 120.40 120.40 1w6m s VAL 2005Ca 0.66 -0.32 0.06 0.00 0.00 0.00 0.00 61.98 62.39 1w6m s VAL 2005Cb -0.39 -0.98 -0.01 0.00 0.00 0.00 0.00 36.38 34.99 1w6m s VAL 2005CO 0.48 0.35 -0.22 0.00 0.00 0.00 0.00 175.10 175.71 1w6m s ALA 2006N 1.33 1.90 0.28 5.51 0.00 0.37 -5.01 121.76 126.14 1w6m s ALA 2006Ca -0.02 -0.96 0.04 0.00 0.00 0.00 0.00 51.96 51.02 1w6m s ALA 2006Cb -0.14 -0.52 -0.06 0.00 0.00 0.00 0.00 23.12 22.40 1w6m s ALA 2006CO -0.04 0.43 0.03 -1.54 0.00 0.00 0.00 175.76 174.64 1w6m s SER 2007N -0.38 2.15 -1.59 0.00 1.04 -1.26 -1.59 113.70 112.09 1w6m s SER 2007Ca 0.04 -1.31 -0.04 0.00 0.48 0.00 0.00 55.95 55.13 1w6m s SER 2007Cb -0.10 -0.05 0.01 0.00 0.10 0.00 0.00 66.02 65.98 1w6m s SER 2007CO 0.00 -0.55 0.48 0.59 0.98 0.00 0.00 173.24 174.74 1w6m n ASN 2008N -0.57 -5.96 -0.05 7.02 4.13 -0.10 -4.87 115.26 114.87 1w6m n ASN 2008Ca -0.03 -0.24 -0.02 0.00 1.68 0.00 0.00 54.58 55.98 1w6m n ASN 2008Cb 0.65 -4.85 0.25 0.00 -1.54 0.00 0.00 39.78 34.29 1w6m n ASN 2008CO 0.00 0.00 0.00 0.25 0.28 0.00 0.00 177.26 177.79 1w6m h LEU 2009N -1.10 0.60 -1.66 3.41 5.85 -1.56 -3.47 115.31 117.38 1w6m h LEU 2009Ca -0.52 -0.12 -0.52 0.00 0.84 0.00 0.00 57.88 57.57 1w6m h LEU 2009Cb 1.36 -0.16 -0.10 0.00 0.37 0.00 0.00 40.66 42.14 1w6m h LEU 2009CO 0.57 0.66 -0.87 -3.20 -0.34 0.00 0.00 178.44 175.26 1w6m n ASN 2010N -4.26 -1.25 -4.69 1.25 5.15 -1.02 -4.90 115.26 105.54 1w6m n ASN 2010Ca 0.02 -1.00 -0.42 0.00 -0.60 0.00 0.00 54.58 52.57 1w6m n ASN 2010Cb 0.25 -2.98 -0.03 0.00 -0.53 0.00 0.00 39.78 36.50 1w6m n ASN 2010CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1w6m s LEU 2011N -7.07 4.28 0.17 1.20 2.96 0.48 -4.85 118.68 115.85 1w6m s LEU 2011Ca 0.22 1.70 0.04 0.00 -0.22 0.00 0.00 54.13 55.87 1w6m s LEU 2011Cb -0.12 -3.56 -0.03 0.00 0.50 0.00 0.00 46.19 42.98 1w6m s LEU 2011CO 0.90 -0.50 0.26 -0.54 -1.32 0.00 0.00 176.35 175.14 1w6m s LYS 2012N 2.00 3.29 0.19 1.98 1.02 -1.26 -0.90 119.74 126.07 1w6m s LYS 2012Ca 0.53 -0.71 -0.33 0.00 0.02 0.00 0.00 55.97 55.48 1w6m s LYS 2012Cb -0.22 -2.86 -0.14 0.00 -0.52 0.00 0.00 37.83 34.09 1w6m s LYS 2012CO 0.21 0.49 1.41 -2.30 -0.92 0.00 0.00 175.35 174.25 1w6m n PRO 2013N -0.69 1.87 0.00 -1.68 -0.02 -1.26 -1.37 135.00 131.85 1w6m n PRO 2013Ca -0.08 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1w6m n PRO 2013Cb 0.55 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 1w6m n PRO 2013CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1w6m n GLY 2014N 2.51 3.28 3.79 -1.23 0.00 -0.80 -4.99 105.19 107.76 1w6m n GLY 2014Ca 0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 1w6m n GLY 2014CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1w6m s GLU 2015N -0.62 4.20 -0.23 1.61 2.02 -0.47 -4.93 118.70 120.28 1w6m s GLU 2015Ca 0.00 1.35 -0.09 0.00 0.02 0.00 0.00 54.97 56.25 1w6m s GLU 2015Cb 0.00 -2.43 -0.04 0.00 0.10 0.00 0.00 34.13 31.76 1w6m s GLU 2015CO 0.00 -0.08 0.12 0.00 0.02 0.00 0.00 175.26 175.32 1w6m s LEU 2017N 1.07 4.30 -0.23 0.00 2.96 0.74 -0.75 118.68 126.76 1w6m s LEU 2017Ca 0.06 -0.72 -0.07 0.00 -0.22 0.00 0.00 54.13 53.18 1w6m s LEU 2017Cb -0.14 -1.99 -0.03 0.00 0.50 0.00 0.00 46.19 44.53 1w6m s LEU 2017CO 0.04 -0.26 0.07 -0.13 -1.32 0.00 0.00 176.35 174.75 1w6m s ARG 2018N 1.58 3.73 -0.14 1.98 0.52 -0.22 -0.43 118.95 125.98 1w6m s ARG 2018Ca 0.03 -0.44 0.02 0.00 -0.52 0.00 0.00 55.73 54.82 1w6m s ARG 2018Cb -0.18 -3.30 0.01 0.00 0.52 0.00 0.00 34.95 32.00 1w6m s ARG 2018CO 0.06 -0.08 -0.22 0.08 0.02 0.00 0.00 175.30 175.17 1w6m s VAL 2019N 1.32 2.12 -0.12 3.52 1.01 -0.36 -0.62 120.40 127.28 1w6m s VAL 2019Ca 0.05 -0.96 0.03 0.00 0.00 0.00 0.00 61.98 61.09 1w6m s VAL 2019Cb -0.15 -1.85 0.01 0.00 0.00 0.00 0.00 36.38 34.40 1w6m s VAL 2019CO 0.04 0.55 -0.20 -0.60 0.00 0.00 0.00 175.10 174.89 1w6m s ARG 2020N 0.76 2.68 0.23 2.72 3.52 0.11 -1.21 118.95 127.76 1w6m s ARG 2020Ca -0.08 -0.74 -0.07 0.00 -0.13 0.00 0.00 55.73 54.72 1w6m s ARG 2020Cb -0.16 -2.16 -0.02 0.00 -1.56 0.00 0.00 34.95 31.05 1w6m s ARG 2020CO -0.01 0.01 0.31 0.20 -0.81 0.00 0.00 175.30 175.01 1w6m s GLY 2021N 0.77 1.01 -0.25 8.12 0.00 -0.72 0.21 107.32 116.45 1w6m s GLY 2021Ca -0.10 -1.30 -0.10 0.00 0.00 0.00 0.00 44.72 43.22 1w6m s GLY 2021CO 0.01 -1.01 0.15 -0.54 0.00 0.00 0.00 173.10 171.71 1w6m s GLU 2022N -4.05 3.97 -0.16 2.90 2.02 0.98 -1.67 118.70 122.70 1w6m s GLU 2022Ca 0.31 -0.32 -0.29 0.00 0.02 0.00 0.00 54.97 54.69 1w6m s GLU 2022Cb 0.03 -3.52 -0.01 0.00 0.10 0.00 0.00 34.13 30.73 1w6m s GLU 2022CO 0.11 -0.03 1.12 0.08 0.02 0.00 0.00 175.26 176.56 1w6m s VAL 2023N 1.30 4.51 0.22 2.63 1.01 -0.04 -1.11 120.40 128.93 1w6m s VAL 2023Ca 0.07 1.82 -0.31 0.00 0.00 0.00 0.00 61.98 63.56 1w6m s VAL 2023Cb -0.14 -4.17 -0.15 0.00 0.00 0.00 0.00 36.38 31.91 1w6m s VAL 2023CO 0.06 -0.10 1.10 0.00 0.00 0.00 0.00 175.10 176.16 1w6m n ALA 2024N 5.93 -0.50 0.06 5.51 0.00 0.32 -1.00 120.51 130.83 1w6m n ALA 2024Ca 0.12 0.43 0.19 0.00 0.00 0.00 0.00 53.44 54.18 1w6m n ALA 2024Cb 0.46 -2.03 0.72 0.00 0.00 0.00 0.00 19.45 18.60 1w6m n ALA 2024CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1w6m h PRO 2025N 2.81 0.00 -0.23 0.00 0.13 -1.90 -1.95 132.00 130.86 1w6m h PRO 2025Ca -0.41 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.62 1w6m h PRO 2025Cb 1.34 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.42 1w6m h PRO 2025CO 0.66 0.00 -0.13 -0.40 -0.23 0.00 0.00 178.00 177.90 1w6m n ASP 2026N -4.20 2.59 -4.75 1.44 5.75 -1.26 -4.23 116.55 111.88 1w6m n ASP 2026Ca 0.07 -3.57 -0.41 0.00 -0.01 0.00 0.00 54.79 50.87 1w6m n ASP 2026Cb 0.54 -0.58 -0.03 0.00 -1.03 0.00 0.00 41.12 40.02 1w6m n ASP 2026CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1w6m s ALA 2027N -3.12 3.45 -0.83 2.12 0.00 -0.77 -4.91 121.76 117.69 1w6m s ALA 2027Ca 0.41 1.00 0.23 0.00 0.00 0.00 0.00 51.96 53.61 1w6m s ALA 2027Cb 0.37 -3.40 0.12 0.00 0.00 0.00 0.00 23.12 20.21 1w6m s ALA 2027CO 0.01 -0.36 1.11 1.63 0.00 0.00 0.00 175.76 178.15 1w6m n LYS 2028N 1.75 0.12 0.00 0.00 4.76 -1.26 -4.85 118.16 118.68 1w6m n LYS 2028Ca 0.02 -0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.45 1w6m n LYS 2028Cb 0.44 -1.54 0.00 0.00 -1.84 0.00 0.00 35.03 32.09 1w6m n LYS 2028CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 1w6m n SER 2029N -1.69 0.00 -3.54 4.39 3.41 -1.26 -1.22 113.62 113.71 1w6m n SER 2029Ca 0.04 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.52 1w6m n SER 2029Cb 0.38 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.28 1w6m n SER 2029CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1w6m s PHE 2030N -2.00 -0.41 0.04 7.33 -0.12 -0.89 -4.71 117.98 117.21 1w6m s PHE 2030Ca 0.00 0.30 0.05 0.00 -0.05 0.00 0.00 56.93 57.23 1w6m s PHE 2030Cb 0.00 0.38 -0.02 0.00 -0.63 0.00 0.00 43.02 42.75 1w6m s PHE 2030CO 0.00 -0.72 -0.15 0.08 -0.05 0.00 0.00 175.22 174.38 1w6m s VAL 2031N -3.14 1.20 -0.16 -2.49 1.01 -1.26 -2.67 120.40 112.88 1w6m s VAL 2031Ca -0.01 -0.99 -0.02 0.00 0.00 0.00 0.00 61.98 60.95 1w6m s VAL 2031Cb -0.00 -1.07 0.05 0.00 0.00 0.00 0.00 36.38 35.36 1w6m s VAL 2031CO -0.07 0.06 0.01 -0.22 0.00 0.00 0.00 175.10 174.88 1w6m s LEU 2032N -1.07 1.12 -0.02 3.92 0.20 -0.23 -2.51 118.68 120.09 1w6m s LEU 2032Ca 0.03 -0.62 -0.01 0.00 0.69 0.00 0.00 54.13 54.22 1w6m s LEU 2032Cb -0.08 -0.61 -0.04 0.00 -0.43 0.00 0.00 46.19 45.03 1w6m s LEU 2032CO 0.01 -0.26 0.05 0.20 -0.29 0.00 0.00 176.35 176.06 1w6m s ASN 2033N 1.85 5.51 0.01 3.68 0.01 0.11 -1.21 114.94 124.89 1w6m s ASN 2033Ca 0.01 0.13 0.00 0.00 -0.71 0.00 0.00 52.86 52.28 1w6m s ASN 2033Cb -0.16 -1.56 -0.01 0.00 0.41 0.00 0.00 41.25 39.94 1w6m s ASN 2033CO -0.07 0.30 -0.01 -0.76 -1.51 0.00 0.00 177.10 175.04 1w6m s LEU 2034N -1.50 2.11 0.00 0.60 1.43 -0.06 -1.21 118.68 120.05 1w6m s LEU 2034Ca 0.20 -0.22 0.00 0.00 -1.03 0.00 0.00 54.13 53.08 1w6m s LEU 2034Cb -0.12 0.04 0.00 0.00 0.03 0.00 0.00 46.19 46.14 1w6m s LEU 2034CO 0.10 -0.13 0.00 0.61 0.23 0.00 0.00 176.35 177.16 1w6m n GLY 2035N 2.42 -0.52 0.12 -3.19 0.00 -0.17 -0.63 105.19 103.22 1w6m n GLY 2035Ca -0.17 -0.70 -0.21 0.00 0.00 0.00 0.00 46.02 44.94 1w6m n GLY 2035CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1w6m h LYS 2036N 0.00 0.18 0.00 1.61 1.57 -1.02 0.57 116.57 119.48 1w6m h LYS 2036Ca 0.00 -0.31 -0.01 0.00 -1.87 0.00 0.00 60.65 58.45 1w6m h LYS 2036Cb 0.00 0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.43 1w6m h LYS 2036CO 0.00 1.15 0.14 -0.40 -0.57 0.00 0.00 179.45 179.77 1w6m n ASP 2037N -4.06 -1.16 0.31 0.86 5.68 -1.18 -4.23 116.55 112.77 1w6m n ASP 2037Ca -0.25 -1.80 0.21 0.00 -0.50 0.00 0.00 54.79 52.45 1w6m n ASP 2037Cb 0.83 1.93 1.09 0.00 -1.14 0.00 0.00 41.12 43.83 1w6m n ASP 2037CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1w6m h SER 2038N 1.00 0.00 -0.01 -1.12 4.64 -1.98 -2.34 113.55 113.73 1w6m h SER 2038Ca -0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 1w6m h SER 2038Cb 0.62 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 1w6m h SER 2038CO 0.21 0.00 -0.48 0.59 -0.87 0.00 0.00 176.83 176.28 1w6m n ASN 2039N -2.98 1.69 -3.60 4.97 3.02 -1.26 -4.76 115.26 112.34 1w6m n ASN 2039Ca -0.02 -1.35 -0.29 0.00 -0.03 0.00 0.00 54.58 52.89 1w6m n ASN 2039Cb 0.10 0.56 -0.13 0.00 -0.61 0.00 0.00 39.78 39.70 1w6m n ASN 2039CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1w6m s ASN 2040N -2.29 3.38 -0.20 6.41 0.01 -0.88 -0.86 114.94 120.51 1w6m s ASN 2040Ca 0.15 -2.29 -0.06 0.00 -0.71 0.00 0.00 52.86 49.95 1w6m s ASN 2040Cb 0.15 -0.71 -0.03 0.00 0.41 0.00 0.00 41.25 41.07 1w6m s ASN 2040CO 0.54 -0.31 0.02 -0.76 -1.51 0.00 0.00 177.10 175.08 1w6m s LEU 2041N 0.86 3.41 0.30 0.60 1.43 0.78 -0.41 118.68 125.65 1w6m s LEU 2041Ca 0.17 -0.14 0.24 0.00 -1.03 0.00 0.00 54.13 53.37 1w6m s LEU 2041Cb -0.23 -1.87 0.35 0.00 0.03 0.00 0.00 46.19 44.47 1w6m s LEU 2041CO -0.03 0.08 1.47 0.00 0.23 0.00 0.00 176.35 178.09 1w6m s LEU 2043N -5.41 -0.67 -0.57 0.00 2.96 -0.80 -4.72 118.68 109.45 1w6m s LEU 2043Ca 0.06 0.75 -0.03 0.00 -0.22 0.00 0.00 54.13 54.69 1w6m s LEU 2043Cb 0.09 1.31 0.15 0.00 0.50 0.00 0.00 46.19 48.24 1w6m s LEU 2043CO 0.69 -0.25 0.39 -2.28 -1.32 0.00 0.00 176.35 173.58 1w6m s HIS 2044N 2.60 3.46 -0.46 5.38 5.65 0.30 -0.88 115.29 131.35 1w6m s HIS 2044Ca 0.04 -2.59 -0.25 0.00 0.25 0.00 0.00 55.06 52.51 1w6m s HIS 2044Cb -0.13 -3.24 0.03 0.00 -1.18 0.00 0.00 32.58 28.06 1w6m s HIS 2044CO -0.14 -0.88 0.88 0.12 -0.65 0.00 0.00 174.74 174.07 1w6m s PHE 2045N 0.29 2.94 -0.55 3.88 5.36 -0.35 -2.44 117.98 127.11 1w6m s PHE 2045Ca 0.14 0.30 0.04 0.00 -0.96 0.00 0.00 56.93 56.46 1w6m s PHE 2045Cb -0.21 -3.88 0.16 0.00 -0.34 0.00 0.00 43.02 38.75 1w6m s PHE 2045CO -0.04 -1.07 0.39 1.21 -1.46 0.00 0.00 175.22 174.25 1w6m s ASN 2046N 2.24 3.50 0.15 6.13 3.04 0.58 -1.07 114.94 129.51 1w6m s ASN 2046Ca 0.35 -3.33 -0.31 0.00 0.04 0.00 0.00 52.86 49.60 1w6m s ASN 2046Cb -0.11 -1.14 -0.08 0.00 -1.54 0.00 0.00 41.25 38.39 1w6m s ASN 2046CO 0.25 -0.15 1.35 -2.84 -3.04 0.00 0.00 177.10 172.67 1w6m s PRO 2047N -0.58 4.35 -0.22 0.43 0.02 -1.09 -1.72 135.00 136.19 1w6m s PRO 2047Ca 0.26 2.06 0.02 0.00 0.02 0.00 0.00 61.00 63.35 1w6m s PRO 2047Cb -0.06 -3.23 0.04 0.00 0.02 0.00 0.00 34.50 31.26 1w6m s PRO 2047CO -0.14 -0.36 -0.15 1.03 -0.33 0.00 0.00 177.00 177.05 1w6m s ARG 2048N 0.63 2.63 -0.09 5.54 0.52 0.13 -2.10 118.95 126.21 1w6m s ARG 2048Ca 0.61 -1.08 -0.25 0.00 -0.52 0.00 0.00 55.73 54.49 1w6m s ARG 2048Cb -0.36 -2.74 -0.21 0.00 0.52 0.00 0.00 34.95 32.15 1w6m s ARG 2048CO 0.33 -0.39 0.89 0.74 0.02 0.00 0.00 175.30 176.89 1w6m h PHE 2049N 7.86 -0.03 -0.78 -0.53 -1.00 -1.44 0.68 116.94 121.70 1w6m h PHE 2049Ca -0.33 -0.00 -0.06 0.00 2.81 0.00 0.00 57.97 60.39 1w6m h PHE 2049Cb 1.09 0.01 -0.17 0.00 3.61 0.00 0.00 35.95 40.49 1w6m h PHE 2049CO 0.56 0.67 -0.37 1.21 -1.61 0.00 0.00 178.31 178.76 1w6m s ASN 2050N -5.90 -1.16 -0.06 2.17 3.04 -0.45 -0.82 114.94 111.76 1w6m s ASN 2050Ca -0.16 -1.00 -0.27 0.00 0.04 0.00 0.00 52.86 51.48 1w6m s ASN 2050Cb -0.01 1.51 0.06 0.00 -1.54 0.00 0.00 41.25 41.27 1w6m s ASN 2050CO 0.61 -0.08 0.59 0.00 -3.04 0.00 0.00 177.10 175.18 1w6m s ALA 2051N 1.37 -1.52 -1.51 1.71 0.00 -0.80 -4.77 121.76 116.24 1w6m s ALA 2051Ca 0.22 1.12 0.00 0.00 0.00 0.00 0.00 51.96 53.30 1w6m s ALA 2051Cb 0.01 -0.06 0.00 0.00 0.00 0.00 0.00 23.12 23.07 1w6m s ALA 2051CO -0.08 -0.34 0.00 0.72 0.00 0.00 0.00 175.76 176.06 1w6m n HIS 2052N 1.13 -0.85 -0.48 0.00 8.25 -1.26 -1.13 115.22 120.88 1w6m n HIS 2052Ca -0.19 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.27 1w6m n HIS 2052Cb 0.57 -3.15 0.00 0.00 1.12 0.00 0.00 29.99 28.53 1w6m n HIS 2052CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1w6m n GLY 2053N -0.67 0.83 3.87 -1.41 0.00 -1.26 -5.06 105.19 101.50 1w6m n GLY 2053Ca -0.18 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.62 1w6m n GLY 2053CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1w6m s ASP 2054N -3.00 5.78 -0.05 1.61 1.01 -0.28 -5.12 116.67 116.61 1w6m s ASP 2054Ca 0.00 -0.13 0.00 0.00 0.71 0.00 0.00 52.55 53.13 1w6m s ASP 2054Cb 0.00 -1.56 0.03 0.00 1.01 0.00 0.00 42.92 42.40 1w6m s ASP 2054CO 0.00 -0.03 -0.02 0.00 0.21 0.00 0.00 175.17 175.34 1w6m s ALA 2055N -2.02 0.58 -1.78 5.23 0.00 -1.26 -1.91 121.76 120.60 1w6m s ALA 2055Ca 0.33 -0.02 -0.21 0.00 0.00 0.00 0.00 51.96 52.06 1w6m s ALA 2055Cb -0.09 -0.50 0.20 0.00 0.00 0.00 0.00 23.12 22.73 1w6m s ALA 2055CO 0.26 -0.18 0.70 0.09 0.00 0.00 0.00 175.76 176.63 1w6m n ASN 2056N 4.43 -2.66 -4.32 0.00 3.02 0.21 -4.94 115.26 111.01 1w6m n ASN 2056Ca -0.19 -1.11 -0.32 0.00 -0.03 0.00 0.00 54.58 52.93 1w6m n ASN 2056Cb 0.50 -2.22 -0.16 0.00 -0.61 0.00 0.00 39.78 37.29 1w6m n ASN 2056CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1w6m s THR 2057N -3.25 2.28 -0.31 3.41 2.01 0.33 -4.62 115.64 115.49 1w6m s THR 2057Ca 0.79 -0.99 -0.20 0.00 0.31 0.00 0.00 61.69 61.60 1w6m s THR 2057Cb -0.44 -1.84 -0.01 0.00 0.01 0.00 0.00 72.50 70.22 1w6m s THR 2057CO 0.97 0.57 0.60 -0.63 -0.69 0.00 0.00 174.62 175.44 1w6m s ILE 2058N -0.30 4.95 -0.17 1.82 1.01 -1.26 0.19 121.20 127.44 1w6m s ILE 2058Ca 0.01 0.75 -0.04 0.00 0.00 0.00 0.00 60.65 61.37 1w6m s ILE 2058Cb -0.13 -3.99 -0.02 0.00 0.01 0.00 0.00 42.46 38.33 1w6m s ILE 2058CO 0.02 -0.15 -0.03 -0.69 0.00 0.00 0.00 174.94 174.09 1w6m s VAL 2059N 2.57 3.83 0.05 2.92 1.01 -0.70 -1.01 120.40 129.07 1w6m s VAL 2059Ca 0.24 -0.37 0.09 0.00 0.00 0.00 0.00 61.98 61.94 1w6m s VAL 2059Cb -0.15 -2.69 -0.03 0.00 0.00 0.00 0.00 36.38 33.51 1w6m s VAL 2059CO 0.12 0.47 -0.25 0.00 0.00 0.00 0.00 175.10 175.44 1w6m s ASN 2061N -1.31 -0.30 0.29 0.00 2.47 -1.02 -1.09 114.94 113.98 1w6m s ASN 2061Ca 0.12 -0.46 0.11 0.00 0.42 0.00 0.00 52.86 53.05 1w6m s ASN 2061Cb -0.10 0.66 -0.05 0.00 -1.45 0.00 0.00 41.25 40.31 1w6m s ASN 2061CO 0.03 -1.20 -0.17 -0.94 -3.72 0.00 0.00 177.10 171.10 1w6m s SER 2062N -2.88 3.67 -0.16 -4.21 1.04 -1.26 -0.54 113.70 109.36 1w6m s SER 2062Ca 0.09 -1.05 -0.03 0.00 0.48 0.00 0.00 55.95 55.45 1w6m s SER 2062Cb -0.04 -0.34 0.05 0.00 0.10 0.00 0.00 66.02 65.79 1w6m s SER 2062CO 0.03 -0.02 0.04 -0.75 0.98 0.00 0.00 173.24 173.52 1w6m s LYS 2063N -3.54 0.52 -0.22 4.02 2.20 -0.33 -1.01 119.74 121.38 1w6m s LYS 2063Ca 0.31 -0.22 -0.02 0.00 -0.36 0.00 0.00 55.97 55.67 1w6m s LYS 2063Cb -0.03 -1.76 0.01 0.00 -1.51 0.00 0.00 37.83 34.53 1w6m s LYS 2063CO 0.16 -0.56 -0.08 0.34 -0.36 0.00 0.00 175.35 174.85 1w6m s ASP 2064N 1.94 4.08 -1.60 1.43 3.68 -0.21 -0.15 116.67 125.84 1w6m s ASP 2064Ca 0.01 -0.56 -0.12 0.00 2.13 0.00 0.00 52.55 54.01 1w6m s ASP 2064Cb -0.16 -1.67 0.10 0.00 -1.45 0.00 0.00 42.92 39.74 1w6m s ASP 2064CO -0.07 -0.04 0.69 -0.67 0.13 0.00 0.00 175.17 175.20 1w6m n ASP 2065N 4.73 -2.55 0.00 -0.34 2.03 -1.13 -1.00 116.55 118.30 1w6m n ASP 2065Ca -0.18 -0.99 0.00 0.00 0.52 0.00 0.00 54.79 54.14 1w6m n ASP 2065Cb 0.50 -2.96 0.00 0.00 -0.72 0.00 0.00 41.12 37.93 1w6m n ASP 2065CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1w6m n GLY 2066N -1.62 2.93 3.70 0.27 0.00 -0.04 -5.04 105.19 105.38 1w6m n GLY 2066Ca -0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.59 1w6m n GLY 2066CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w6m s ALA 2067N -2.08 3.51 0.29 4.61 0.00 -0.17 -5.03 121.76 122.89 1w6m s ALA 2067Ca 0.00 -0.29 -0.29 0.00 0.00 0.00 0.00 51.96 51.38 1w6m s ALA 2067Cb 0.00 -2.69 -0.10 0.00 0.00 0.00 0.00 23.12 20.34 1w6m s ALA 2067CO 0.00 -0.16 1.10 -1.58 0.00 0.00 0.00 175.76 175.13 1w6m s TRP 2068N 0.99 3.55 0.00 0.00 0.52 -1.26 -1.04 118.94 121.69 1w6m s TRP 2068Ca 0.24 1.69 0.00 0.00 0.02 0.00 0.00 56.10 58.05 1w6m s TRP 2068Cb -0.15 -3.29 0.00 0.00 -1.15 0.00 0.00 33.47 28.88 1w6m s TRP 2068CO 0.10 -0.59 0.00 0.41 0.02 0.00 0.00 176.95 176.89 1w6m n GLY 2069N 1.13 0.81 3.69 0.98 0.00 -0.18 -4.96 105.19 106.66 1w6m n GLY 2069Ca -0.01 -1.85 -0.40 0.00 0.00 0.00 0.00 46.02 43.76 1w6m n GLY 2069CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1w6m s THR 2070N 1.18 4.98 0.70 2.61 2.01 -1.26 -4.82 115.64 121.04 1w6m s THR 2070Ca 0.00 1.45 -0.15 0.00 0.31 0.00 0.00 61.69 63.30 1w6m s THR 2070Cb 0.00 -4.05 0.02 0.00 0.01 0.00 0.00 72.50 68.48 1w6m s THR 2070CO 0.00 0.14 1.16 -1.61 -0.69 0.00 0.00 174.62 173.62 1w6m s GLU 2071N 1.55 2.41 -0.04 4.92 2.02 -1.26 -4.75 118.70 123.54 1w6m s GLU 2071Ca 0.36 1.58 0.02 0.00 0.02 0.00 0.00 54.97 56.95 1w6m s GLU 2071Cb -0.17 -1.88 0.01 0.00 0.10 0.00 0.00 34.13 32.19 1w6m s GLU 2071CO 0.14 -1.59 -0.09 -0.65 0.02 0.00 0.00 175.26 173.10 1w6m s GLN 2072N -4.01 1.16 -0.10 1.61 -0.21 -0.25 -4.99 119.66 112.88 1w6m s GLN 2072Ca 0.71 -0.27 -0.02 0.00 0.02 0.00 0.00 55.36 55.79 1w6m s GLN 2072Cb -0.25 -1.04 -0.03 0.00 1.00 0.00 0.00 33.01 32.68 1w6m s GLN 2072CO 0.44 0.02 0.01 1.03 -2.12 0.00 0.00 175.29 174.66 1w6m s ARG 2073N 0.59 3.12 0.51 2.91 0.52 -1.26 -0.96 118.95 124.39 1w6m s ARG 2073Ca -0.10 -0.41 -0.06 0.00 -0.52 0.00 0.00 55.73 54.64 1w6m s ARG 2073Cb -0.13 -2.84 -0.03 0.00 0.52 0.00 0.00 34.95 32.47 1w6m s ARG 2073CO 0.01 0.63 0.82 -1.21 0.02 0.00 0.00 175.30 175.58 1w6m s GLU 2074N -0.69 3.48 0.05 3.54 0.41 -0.18 -5.01 118.70 120.31 1w6m s GLU 2074Ca 0.11 0.23 0.28 0.00 -0.41 0.00 0.00 54.97 55.18 1w6m s GLU 2074Cb -0.12 -2.33 1.00 0.00 -1.78 0.00 0.00 34.13 30.90 1w6m s GLU 2074CO 0.02 -0.30 1.80 0.00 -0.49 0.00 0.00 175.26 176.29 1w6m n ALA 2075N -2.35 2.51 -2.42 5.21 0.00 -1.26 -4.61 120.51 117.60 1w6m n ALA 2075Ca 0.02 -0.13 -0.21 0.00 0.00 0.00 0.00 53.44 53.12 1w6m n ALA 2075Cb 0.55 -1.41 -0.10 0.00 0.00 0.00 0.00 19.45 18.50 1w6m n ALA 2075CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1w6m s VAL 2076N -3.03 0.81 -0.47 0.00 -7.23 -1.26 -5.11 120.40 104.11 1w6m s VAL 2076Ca 0.12 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.36 1w6m s VAL 2076Cb 0.17 -2.62 0.23 0.00 0.56 0.00 0.00 36.38 34.72 1w6m s VAL 2076CO 0.58 0.00 0.73 0.33 -0.31 0.00 0.00 175.10 176.43 1w6m n PHE 2077N -0.68 -2.59 -1.41 2.82 -0.00 -1.26 -4.46 117.46 109.89 1w6m n PHE 2077Ca -0.02 -2.21 -0.26 0.00 -0.00 0.00 0.00 57.45 54.95 1w6m n PHE 2077Cb 0.66 1.02 -0.08 0.00 -0.00 0.00 0.00 39.48 41.08 1w6m n PHE 2077CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.76 176.41 1w6m n PRO 2078N 1.94 2.86 -4.15 -7.13 -0.04 -1.26 -4.89 135.00 122.33 1w6m n PRO 2078Ca 0.15 -2.12 -0.15 0.00 -0.04 0.00 0.00 63.50 61.34 1w6m n PRO 2078Cb 0.58 -2.28 -0.11 0.00 -0.04 0.00 0.00 33.50 31.65 1w6m n PRO 2078CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1w6m s PHE 2079N -0.26 1.02 -0.13 0.54 0.40 -1.26 -4.72 117.98 113.57 1w6m s PHE 2079Ca 0.62 -0.57 -0.12 0.00 -0.60 0.00 0.00 56.93 56.26 1w6m s PHE 2079Cb 0.30 -0.57 0.04 0.00 0.51 0.00 0.00 43.02 43.30 1w6m s PHE 2079CO -0.11 -0.00 0.35 -1.14 0.70 0.00 0.00 175.22 175.02 1w6m s GLN 2080N -2.26 0.40 0.65 0.44 0.74 -1.26 -5.10 119.66 113.27 1w6m s GLN 2080Ca 0.00 0.50 -0.18 0.00 0.05 0.00 0.00 55.36 55.74 1w6m s GLN 2080Cb -0.06 0.17 -0.01 0.00 1.10 0.00 0.00 33.01 34.21 1w6m s GLN 2080CO 0.01 -0.06 1.27 -2.14 -0.55 0.00 0.00 175.29 173.82 1w6m s PRO 2081N 0.30 2.57 -1.07 1.67 0.02 -1.26 -3.63 135.00 133.59 1w6m s PRO 2081Ca -0.01 1.99 -0.03 0.00 0.02 0.00 0.00 61.00 62.97 1w6m s PRO 2081Cb -0.03 -1.86 0.00 0.00 0.02 0.00 0.00 34.50 32.64 1w6m s PRO 2081CO -0.01 -1.57 0.91 0.41 -0.33 0.00 0.00 177.00 176.42 1w6m n GLY 2082N 0.78 -0.27 3.62 0.52 0.00 -0.17 -4.83 105.19 104.84 1w6m n GLY 2082Ca 0.15 0.05 -0.09 0.00 0.00 0.00 0.00 46.02 46.14 1w6m n GLY 2082CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1w6m s SER 2083N -3.79 -0.24 -0.11 1.61 1.04 -1.17 -4.89 113.70 106.14 1w6m s SER 2083Ca 0.20 -0.58 -0.20 0.00 0.48 0.00 0.00 55.95 55.85 1w6m s SER 2083Cb -0.09 0.62 -0.04 0.00 0.10 0.00 0.00 66.02 66.62 1w6m s SER 2083CO 0.62 -1.15 0.58 -0.69 0.98 0.00 0.00 173.24 173.58 1w6m s VAL 2084N -3.91 5.11 -0.01 5.02 1.01 -1.26 -0.86 120.40 125.51 1w6m s VAL 2084Ca 0.12 1.16 0.02 0.00 0.00 0.00 0.00 61.98 63.28 1w6m s VAL 2084Cb -0.02 -3.91 -0.00 0.00 0.00 0.00 0.00 36.38 32.44 1w6m s VAL 2084CO 0.02 0.27 -0.07 0.00 0.00 0.00 0.00 175.10 175.32 1w6m s ALA 2085N 0.88 0.60 -0.04 5.51 0.00 -0.67 -4.99 121.76 123.06 1w6m s ALA 2085Ca 0.30 -0.27 0.06 0.00 0.00 0.00 0.00 51.96 52.06 1w6m s ALA 2085Cb -0.16 -0.19 -0.01 0.00 0.00 0.00 0.00 23.12 22.76 1w6m s ALA 2085CO 0.13 0.12 -0.22 -2.00 0.00 0.00 0.00 175.76 173.79 1w6m s GLU 2086N -0.00 2.04 0.11 0.00 2.12 -1.26 -1.76 118.70 119.94 1w6m s GLU 2086Ca 0.00 -0.79 0.09 0.00 0.36 0.00 0.00 54.97 54.64 1w6m s GLU 2086Cb -0.05 -1.83 -0.04 0.00 0.26 0.00 0.00 34.13 32.48 1w6m s GLU 2086CO -0.00 0.39 -0.23 0.14 -0.54 0.00 0.00 175.26 175.02 1w6m s VAL 2087N -0.27 1.87 -0.10 3.70 -7.23 -0.35 -3.24 120.40 114.77 1w6m s VAL 2087Ca 0.02 -1.58 0.03 0.00 -1.81 0.00 0.00 61.98 58.63 1w6m s VAL 2087Cb -0.11 -1.68 0.01 0.00 0.56 0.00 0.00 36.38 35.16 1w6m s VAL 2087CO 0.01 -0.00 -0.19 0.00 -0.31 0.00 0.00 175.10 174.61 1w6m s ILE 2089N 0.64 1.33 0.20 0.00 1.01 0.43 -0.31 121.20 124.50 1w6m s ILE 2089Ca -0.13 -0.82 -0.05 0.00 0.00 0.00 0.00 60.65 59.64 1w6m s ILE 2089Cb -0.16 -1.13 -0.03 0.00 0.01 0.00 0.00 42.46 41.15 1w6m s ILE 2089CO 0.04 0.29 0.24 0.28 0.00 0.00 0.00 174.94 175.79 1w6m s THR 2090N -0.51 0.03 0.12 2.92 -1.32 -0.79 -0.18 115.64 115.89 1w6m s THR 2090Ca 0.06 -1.72 -0.25 0.00 -1.21 0.00 0.00 61.69 58.56 1w6m s THR 2090Cb -0.07 -2.24 0.07 0.00 -1.51 0.00 0.00 72.50 68.75 1w6m s THR 2090CO -0.00 -0.12 0.75 0.72 -2.21 0.00 0.00 174.62 173.77 1w6m s PHE 2091N -4.07 -0.39 0.29 9.09 -0.71 -1.26 -0.37 117.98 120.56 1w6m s PHE 2091Ca 0.29 0.16 0.03 0.00 -1.04 0.00 0.00 56.93 56.38 1w6m s PHE 2091Cb 0.04 0.58 -0.04 0.00 -1.21 0.00 0.00 43.02 42.40 1w6m s PHE 2091CO 0.08 -0.79 0.18 0.16 -1.34 0.00 0.00 175.22 173.51 1w6m s ASP 2092N -2.70 1.30 0.60 1.98 1.47 -0.55 -1.91 116.67 116.87 1w6m s ASP 2092Ca 0.05 -1.58 0.32 0.00 1.18 0.00 0.00 52.55 52.52 1w6m s ASP 2092Cb -0.02 0.43 1.89 0.00 -0.34 0.00 0.00 42.92 44.88 1w6m s ASP 2092CO -0.08 -0.92 2.25 0.06 0.68 0.00 0.00 175.17 177.16 1w6m h GLN 2093N 2.27 0.00 0.07 2.11 -0.00 -1.94 -3.15 115.11 114.48 1w6m h GLN 2093Ca -0.32 0.00 -0.26 0.00 -0.00 0.00 0.00 58.65 58.07 1w6m h GLN 2093Cb 1.25 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 28.71 1w6m h GLN 2093CO 0.48 0.00 -1.40 0.00 -0.00 0.00 0.00 178.83 177.92 1w6m h ALA 2094N 1.96 0.25 -2.38 0.06 0.00 -1.93 -3.42 119.26 113.79 1w6m h ALA 2094Ca 0.01 -1.16 -0.11 0.00 0.00 0.00 0.00 54.91 53.65 1w6m h ALA 2094Cb 0.08 0.59 -0.15 0.00 0.00 0.00 0.00 17.79 18.31 1w6m h ALA 2094CO -0.00 0.83 -0.55 -0.80 0.00 0.00 0.00 179.25 178.73 1w6m s ASN 2095N -6.93 0.32 0.03 0.00 0.01 -1.19 -0.67 114.94 106.52 1w6m s ASN 2095Ca -0.24 -0.82 0.01 0.00 -0.71 0.00 0.00 52.86 51.11 1w6m s ASN 2095Cb 0.05 0.25 -0.04 0.00 0.41 0.00 0.00 41.25 41.92 1w6m s ASN 2095CO 0.70 -0.63 0.08 -0.76 -1.51 0.00 0.00 177.10 174.98 1w6m s LEU 2096N -2.79 3.86 -0.15 0.60 1.02 0.86 -1.49 118.68 120.59 1w6m s LEU 2096Ca 0.05 0.08 0.02 0.00 0.02 0.00 0.00 54.13 54.30 1w6m s LEU 2096Cb 0.06 -2.37 0.01 0.00 0.02 0.00 0.00 46.19 43.91 1w6m s LEU 2096CO -0.10 0.23 -0.21 -0.89 0.02 0.00 0.00 176.35 175.40 1w6m s THR 2097N -1.28 2.02 -0.21 5.49 2.01 0.50 -0.98 115.64 123.19 1w6m s THR 2097Ca 0.26 -0.94 -0.03 0.00 0.31 0.00 0.00 61.69 61.29 1w6m s THR 2097Cb -0.12 -1.80 -0.00 0.00 0.01 0.00 0.00 72.50 70.59 1w6m s THR 2097CO 0.18 0.54 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.88 1w6m s VAL 2098N 0.95 3.10 -0.16 3.82 1.01 0.05 -1.89 120.40 127.28 1w6m s VAL 2098Ca -0.04 -0.59 -0.06 0.00 0.00 0.00 0.00 61.98 61.29 1w6m s VAL 2098Cb -0.15 -2.39 -0.04 0.00 0.00 0.00 0.00 36.38 33.80 1w6m s VAL 2098CO -0.05 0.45 0.03 -0.75 0.00 0.00 0.00 175.10 174.79 1w6m s LYS 2099N 1.39 3.80 0.52 2.72 2.20 0.58 -1.27 119.74 129.67 1w6m s LYS 2099Ca 0.05 -0.39 0.04 0.00 -0.36 0.00 0.00 55.97 55.31 1w6m s LYS 2099Cb -0.14 -3.10 0.04 0.00 -1.51 0.00 0.00 37.83 33.12 1w6m s LYS 2099CO -0.05 0.32 0.73 -0.51 -0.36 0.00 0.00 175.35 175.48 1w6m s LEU 2100N 0.21 3.36 0.51 5.43 1.43 0.16 -1.26 118.68 128.51 1w6m s LEU 2100Ca 0.02 -0.29 0.25 0.00 -1.03 0.00 0.00 54.13 53.09 1w6m s LEU 2100Cb -0.13 -2.57 1.35 0.00 0.03 0.00 0.00 46.19 44.88 1w6m s LEU 2100CO 0.01 -1.10 1.96 -0.65 0.23 0.00 0.00 176.35 176.79 1w6m h PRO 2101N 0.22 0.08 -0.15 1.29 0.11 -1.83 -0.15 132.00 131.57 1w6m h PRO 2101Ca -0.39 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1w6m h PRO 2101Cb 1.29 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1w6m h PRO 2101CO 0.47 0.05 0.00 -0.40 -0.21 0.00 0.00 178.00 177.91 1w6m n ASP 2102N -4.37 1.03 0.00 -2.05 5.75 -1.26 -4.88 116.55 110.76 1w6m n ASP 2102Ca 0.13 -1.77 0.00 0.00 -0.01 0.00 0.00 54.79 53.13 1w6m n ASP 2102Cb 0.68 -0.10 0.00 0.00 -1.03 0.00 0.00 41.12 40.67 1w6m n ASP 2102CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1w6m n GLY 2103N 0.92 1.61 3.76 6.12 0.00 -0.07 -5.02 105.19 112.51 1w6m n GLY 2103Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 1w6m n GLY 2103CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1w6m s TYR 2104N -3.08 3.54 0.00 1.61 5.04 -1.26 -4.76 117.35 118.45 1w6m s TYR 2104Ca 0.00 1.71 0.01 0.00 -2.44 0.00 0.00 57.07 56.35 1w6m s TYR 2104Cb 0.00 -3.21 -0.01 0.00 0.35 0.00 0.00 41.96 39.09 1w6m s TYR 2104CO 0.00 -0.46 -0.05 -1.83 -1.34 0.00 0.00 175.55 171.87 1w6m s GLU 2105N -1.70 0.37 0.27 4.97 -1.05 -1.26 0.35 118.70 120.66 1w6m s GLU 2105Ca 0.48 -0.26 0.02 0.00 -0.15 0.00 0.00 54.97 55.05 1w6m s GLU 2105Cb -0.29 -0.31 -0.05 0.00 -0.44 0.00 0.00 34.13 33.04 1w6m s GLU 2105CO 0.36 0.08 0.11 -0.59 0.95 0.00 0.00 175.26 176.18 1w6m s PHE 2106N -0.35 1.55 0.11 4.83 -0.71 -0.40 -4.96 117.98 118.05 1w6m s PHE 2106Ca -0.01 -1.23 0.09 0.00 -1.04 0.00 0.00 56.93 54.75 1w6m s PHE 2106Cb -0.03 -0.89 -0.04 0.00 -1.21 0.00 0.00 43.02 40.85 1w6m s PHE 2106CO -0.00 -0.38 -0.21 0.15 -1.34 0.00 0.00 175.22 173.44 1w6m s LYS 2107N -3.99 1.72 -0.06 1.99 1.02 -1.26 -0.77 119.74 118.39 1w6m s LYS 2107Ca 0.37 -1.19 0.00 0.00 0.02 0.00 0.00 55.97 55.17 1w6m s LYS 2107Cb 0.07 -2.06 0.02 0.00 -0.52 0.00 0.00 37.83 35.35 1w6m s LYS 2107CO 0.14 0.48 -0.05 0.12 -0.92 0.00 0.00 175.35 175.13 1w6m s PHE 2108N -1.07 0.95 0.23 3.18 5.36 -0.15 -4.95 117.98 121.53 1w6m s PHE 2108Ca 0.16 -0.33 -0.31 0.00 -0.96 0.00 0.00 56.93 55.49 1w6m s PHE 2108Cb -0.10 -0.85 -0.14 0.00 -0.34 0.00 0.00 43.02 41.59 1w6m s PHE 2108CO 0.08 -0.29 1.22 -2.30 -1.46 0.00 0.00 175.22 172.47 1w6m n PRO 2109N 4.40 1.58 -2.85 10.12 -0.02 -1.26 -0.10 135.00 146.87 1w6m n PRO 2109Ca -0.19 0.56 -0.44 0.00 -2.02 0.00 0.00 63.50 61.42 1w6m n PRO 2109Cb 0.51 -2.09 -0.01 0.00 -0.02 0.00 0.00 33.50 31.89 1w6m n PRO 2109CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1w6m s ASN 2110N -0.05 6.93 0.36 2.55 3.84 0.16 -4.72 114.94 124.01 1w6m s ASN 2110Ca 0.67 -2.67 0.27 0.00 0.21 0.00 0.00 52.86 51.35 1w6m s ASN 2110Cb -0.73 -2.45 1.06 0.00 -0.55 0.00 0.00 41.25 38.59 1w6m s ASN 2110CO 0.54 -0.92 1.80 0.03 -2.79 0.00 0.00 177.10 175.76 1w6m h ARG 2111N 7.62 0.00 -0.01 0.43 3.08 -1.85 -2.57 114.38 121.08 1w6m h ARG 2111Ca 0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.36 1w6m h ARG 2111Cb 0.90 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.95 1w6m h ARG 2111CO 1.28 0.00 -0.35 1.28 -1.07 0.00 0.00 179.97 181.10 1w6m n LEU 2112N -2.56 1.46 -2.16 3.04 4.32 -1.26 -4.94 117.00 114.90 1w6m n LEU 2112Ca 0.02 -0.48 -0.21 0.00 -0.02 0.00 0.00 56.01 55.32 1w6m n LEU 2112Cb 0.29 -0.07 -0.03 0.00 -1.62 0.00 0.00 43.42 41.99 1w6m n LEU 2112CO 0.24 0.27 -0.25 0.59 -1.22 0.00 0.00 177.39 177.03 1w6m n ASN 2113N -0.38 -5.77 -4.73 -1.43 5.03 -0.97 -4.91 115.26 102.10 1w6m n ASN 2113Ca 0.11 0.15 -0.42 0.00 0.87 0.00 0.00 54.58 55.28 1w6m n ASN 2113Cb 0.40 -4.89 -0.01 0.00 -1.02 0.00 0.00 39.78 34.26 1w6m n ASN 2113CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1w6m n LEU 2114N -2.82 4.14 -0.50 3.41 4.32 -1.26 -4.90 117.00 119.39 1w6m n LEU 2114Ca -0.24 1.19 0.06 0.00 -0.02 0.00 0.00 56.01 57.01 1w6m n LEU 2114Cb 0.69 -1.55 0.07 0.00 -1.62 0.00 0.00 43.42 41.00 1w6m n LEU 2114CO 0.30 -0.10 0.46 -0.62 -1.22 0.00 0.00 177.39 176.21 1w6m n GLU 2115N 1.04 0.95 -3.61 3.23 1.02 -1.26 -4.57 120.64 117.44 1w6m n GLU 2115Ca 0.05 -1.33 -0.13 0.00 -0.02 0.00 0.00 57.16 55.74 1w6m n GLU 2115Cb 0.37 -1.23 -0.07 0.00 -0.02 0.00 0.00 31.44 30.49 1w6m n GLU 2115CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1w6m s ALA 2116N -0.98 -1.86 -0.25 0.62 0.00 -1.26 -4.26 121.76 113.77 1w6m s ALA 2116Ca 0.15 1.84 -0.04 0.00 0.00 0.00 0.00 51.96 53.92 1w6m s ALA 2116Cb 0.10 -1.07 0.01 0.00 0.00 0.00 0.00 23.12 22.16 1w6m s ALA 2116CO 0.15 -0.31 -0.02 0.42 0.00 0.00 0.00 175.76 176.01 1w6m s ILE 2117N -0.01 3.37 -0.49 0.00 1.01 -0.08 -4.84 121.20 120.15 1w6m s ILE 2117Ca -0.00 -0.72 0.10 0.00 0.00 0.00 0.00 60.65 60.03 1w6m s ILE 2117Cb -0.04 -2.64 -0.11 0.00 0.01 0.00 0.00 42.46 39.67 1w6m s ILE 2117CO -0.00 0.26 0.44 0.59 0.00 0.00 0.00 174.94 176.23 1w6m n ASN 2118N 4.77 0.49 -4.14 3.58 4.13 -0.97 -0.39 115.26 122.74 1w6m n ASN 2118Ca -0.17 -0.75 -0.23 0.00 1.68 0.00 0.00 54.58 55.11 1w6m n ASN 2118Cb 0.49 1.00 -0.15 0.00 -1.54 0.00 0.00 39.78 39.58 1w6m n ASN 2118CO 0.00 0.00 0.00 -0.47 0.28 0.00 0.00 177.26 177.07 1w6m s TYR 2119N -1.98 1.41 -0.07 3.10 5.04 0.15 -0.92 117.35 124.08 1w6m s TYR 2119Ca 0.04 -0.27 -0.09 0.00 -2.44 0.00 0.00 57.07 54.30 1w6m s TYR 2119Cb 0.08 -0.91 0.02 0.00 0.35 0.00 0.00 41.96 41.50 1w6m s TYR 2119CO 0.43 -0.02 0.24 1.41 -1.34 0.00 0.00 175.55 176.27 1w6m s MET 2120N -0.42 0.37 -0.18 4.97 -2.45 -0.62 -1.00 119.30 119.96 1w6m s MET 2120Ca 0.06 0.17 -0.16 0.00 -1.25 0.00 0.00 55.69 54.50 1w6m s MET 2120Cb -0.06 0.17 0.05 0.00 1.25 0.00 0.00 34.83 36.24 1w6m s MET 2120CO -0.00 -0.07 0.48 0.00 1.05 0.00 0.00 175.02 176.48 1w6m s ALA 2121N -0.28 -1.19 0.15 4.11 0.00 -0.35 -0.48 121.76 123.72 1w6m s ALA 2121Ca -0.04 1.38 0.08 0.00 0.00 0.00 0.00 51.96 53.38 1w6m s ALA 2121Cb -0.03 -0.80 -0.04 0.00 0.00 0.00 0.00 23.12 22.25 1w6m s ALA 2121CO 0.01 -0.23 -0.11 0.00 0.00 0.00 0.00 175.76 175.43 1w6m s ALA 2122N 0.31 2.92 0.45 0.00 0.00 -0.25 0.08 121.76 125.26 1w6m s ALA 2122Ca -0.00 -1.38 -0.00 0.00 0.00 0.00 0.00 51.96 50.58 1w6m s ALA 2122Cb -0.04 -0.78 0.02 0.00 0.00 0.00 0.00 23.12 22.32 1w6m s ALA 2122CO -0.00 0.54 0.12 -0.40 0.00 0.00 0.00 175.76 176.02 1w6m n ASP 2123N 0.36 0.15 0.09 0.00 3.85 -1.04 -0.49 116.55 119.47 1w6m n ASP 2123Ca -0.12 -1.13 0.09 0.00 -0.71 0.00 0.00 54.79 52.92 1w6m n ASP 2123Cb 0.54 -0.08 0.41 0.00 -1.35 0.00 0.00 41.12 40.64 1w6m n ASP 2123CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1w6m n GLY 2124N 4.12 -0.99 0.40 6.12 0.00 -1.26 -2.79 105.19 110.79 1w6m n GLY 2124Ca 0.02 0.08 0.12 0.00 0.00 0.00 0.00 46.02 46.23 1w6m n GLY 2124CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1w6m n ASP 2125N -1.98 1.68 -3.93 1.61 10.43 -1.26 -4.73 116.55 118.37 1w6m n ASP 2125Ca 0.01 -1.30 -0.31 0.00 2.57 0.00 0.00 54.79 55.76 1w6m n ASP 2125Cb 0.13 0.38 -0.15 0.00 1.84 0.00 0.00 41.12 43.32 1w6m n ASP 2125CO 0.00 0.00 0.00 0.12 -1.07 0.00 0.00 177.20 176.25 1w6m s PHE 2126N -2.50 2.96 -0.57 1.24 5.36 -1.12 -0.52 117.98 122.83 1w6m s PHE 2126Ca 0.20 -2.44 -0.21 0.00 -0.96 0.00 0.00 56.93 53.52 1w6m s PHE 2126Cb 0.18 -2.35 0.07 0.00 -0.34 0.00 0.00 43.02 40.58 1w6m s PHE 2126CO 0.56 -0.90 0.78 0.21 -1.46 0.00 0.00 175.22 174.41 1w6m s LYS 2127N 1.19 3.15 0.14 10.12 2.20 -0.27 -4.49 119.74 131.77 1w6m s LYS 2127Ca 0.08 -0.84 -0.31 0.00 -0.36 0.00 0.00 55.97 54.54 1w6m s LYS 2127Cb -0.18 -4.15 -0.10 0.00 -1.51 0.00 0.00 37.83 31.88 1w6m s LYS 2127CO -0.13 -1.48 1.63 0.42 -0.36 0.00 0.00 175.35 175.44 1w6m s ILE 2128N 3.24 2.68 -0.02 5.43 1.01 -1.26 -0.01 121.20 132.26 1w6m s ILE 2128Ca 0.19 0.38 0.07 0.00 0.00 0.00 0.00 60.65 61.29 1w6m s ILE 2128Cb -0.18 -3.24 -0.11 0.00 0.01 0.00 0.00 42.46 38.93 1w6m s ILE 2128CO 0.12 0.02 0.15 0.29 0.00 0.00 0.00 174.94 175.51 1w6m n LYS 2129N 4.61 0.58 -3.68 2.79 4.76 0.13 -4.92 118.16 122.44 1w6m n LYS 2129Ca 0.15 -0.06 -0.13 0.00 -2.87 0.00 0.00 58.31 55.40 1w6m n LYS 2129Cb 0.39 -1.18 -0.08 0.00 -1.84 0.00 0.00 35.03 32.31 1w6m n LYS 2129CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1w6m s VAL 2131N 0.36 0.41 0.07 0.00 1.01 -1.26 -0.71 120.40 120.28 1w6m s VAL 2131Ca -0.00 0.01 0.05 0.00 0.00 0.00 0.00 61.98 62.03 1w6m s VAL 2131Cb -0.04 -0.49 -0.03 0.00 0.00 0.00 0.00 36.38 35.82 1w6m s VAL 2131CO 0.00 0.22 -0.15 0.00 0.00 0.00 0.00 175.10 175.18 1w6m s ALA 2132N 1.31 1.21 -0.24 5.51 0.00 0.21 -4.98 121.76 124.77 1w6m s ALA 2132Ca -0.05 -1.00 0.02 0.00 0.00 0.00 0.00 51.96 50.92 1w6m s ALA 2132Cb -0.13 -0.11 0.06 0.00 0.00 0.00 0.00 23.12 22.93 1w6m s ALA 2132CO -0.02 0.18 -0.09 -0.06 0.00 0.00 0.00 175.76 175.77 1w6m s PHE 2133N -1.24 2.78 0.00 0.00 0.40 -1.26 -1.06 117.98 117.61 1w6m s PHE 2133Ca -0.01 -1.97 0.00 0.00 -0.60 0.00 0.00 56.93 54.34 1w6m s PHE 2133Cb -0.10 -1.75 0.00 0.00 0.51 0.00 0.00 43.02 41.68 1w6m s PHE 2133CO 0.02 -0.82 0.00 -0.40 0.70 0.00 0.00 175.22 174.73